SCHEMBL27926367

SCHEMBL27926367

[Zn].c1ccc(-c2nnn[nH]2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 4/20 0.42
NR1H3 Q13133 4/20 0.42
BTK Q06187 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
DCUN1D1 Q96GG9 3/20 0.39
MTOR P42345 1/20 0.39
ADK P55263 1/20 0.39
NISCH Q9Y2I1 1/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
MAPK1 P28482 1/20 0.39
NPY5R Q15761 1/20 0.38
SCN2A Q99250 1/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4950 0.98 NR1H2 (0.43) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL28994299 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL29402664 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL2954445 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
Bromide SCHEMBL8589844 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
Water SCHEMBL7382263 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL3962514 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
Selenium SCHEMBL30289776 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL22498864 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL10635278 0.95 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103360334-A Aqueous-phase synthesis method of 5-phenyl-1H-tetrazole ZHEJIANG HAILAN CHEMICAL CO LTD 2013-10-23 CN claimed
CN-103351353-A Aqueous phase synthesis method of 5-methyl tetrazole ZHEJIANG HAILAN CHEMICAL CO LTD 2013-10-16 CN claimed
CN-112317143-A Filtering centrifugal separator for synthesizing 5-methyltetrazole 濮阳天健生物科技有限公司 2021-02-05 CN disclosed
CN-105237490-A Synthesis method of 5-methyl tetrazole JIANGSU HENG XIANG CHEMICAL CO LTD 2016-01-13 CN disclosed
CN-103360334-A Aqueous-phase synthesis method of 5-phenyl-1H-tetrazole ZHEJIANG HAILAN CHEMICAL CO LTD 2013-10-23 CN disclosed
CN-103360334-A Aqueous-phase synthesis method of 5-phenyl-1H-tetrazole ZHEJIANG HAILAN CHEMICAL CO LTD 2013-10-23 CN disclosed
CN-103351353-A Aqueous phase synthesis method of 5-methyl tetrazole ZHEJIANG HAILAN CHEMICAL CO LTD 2013-10-16 CN disclosed
CN-103351353-A Aqueous phase synthesis method of 5-methyl tetrazole ZHEJIANG HAILAN CHEMICAL CO LTD 2013-10-16 CN disclosed